[2-(7,8-dimethoxyphenanthren-1-yl)phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [2-(7,8-dimethoxyphenanthren-1-yl)phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [2-(7,8-dimethoxy-1-phenanthryl)phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2-(7,8-dimethoxy-1-phenanthrenyl)phenyl] ester IUPAC Name: [2-(7,8-dimethoxyphenanthren-1-yl)phenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2-(7,8-dimethoxy-1-phenanthryl)phenyl] ester Formula: C23H17F3O5S MolecularWeight: 462.43829

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C3=C(C=C2)C(=CC=C3)C4=CC=CC=C4OS(=O)(=O)C(F)(F)F)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C3=C(C=C2)C(=CC=C3)C4=CC=CC=C4OS(=O)(=O)C(F)(F)F)OC

InChI

InChI=1S/C23H17F3O5S/c1-29-21-13-12-17-14-7-5-8-15(16(14)10-11-19(17)22(21)30-2)18-6-3-4-9-20(18)31-32(27,28)23(24,25)26/h3-13H,1-2H3